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| CAS No.: | 693-03-8 |
|---|---|
| Name: | N-BUTYLMAGNESIUM BROMIDE |
| Article Data: | 24 |
| Molecular Structure: | |
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| Formula: | C4H9BrMg |
| Molecular Weight: | 161.324 |
| Synonyms: | Butylmagnesiumbromide (6CI);1-Butylmagnesium bromide;Bromobutylmagnesium;n-Butylmagnesiumbromide; |
| EINECS: | 211-737-4 |
| Melting Point: | 80.5-81 °C |
| Boiling Point: | 128-131 °C(Press: 0.2 Torr) |
| PSA: | 0.00000 |
| LogP: | 2.59970 |
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- Total:32 Page 1 of 1 1
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Specification
This chemical is called Magnesium, bromobutyl-, and its systematic name is Bromobutylmagnesium. With the molecular formula of C4H9BrMg, its molecular weight is 161.32. The CAS registry number of this chemical is 693-03-8.
Other characteristics of the Magnesium, bromobutyl- can be summarised as followings: (1)H-Bond Donor: 0; (2)H-Bond Acceptor: 2; (3)Rotatable Bond Count: 1; (4)Exact Mass: 159.973805; (5)MonoIsotopic Mass: 159.973805; (6)Topological Polar Surface Area: 0; (7)Heavy Atom Count: 6; (8)Formal Charge: 0; (9)Complexity: 11.5; (10)Covalently-Bonded Unit Count: 3.
Uses of this chemical: The Magnesium, bromobutyl- could react with furfural, and obtain the 1-furan-2-yl-pentan-1-ol. This reaction needs the solvent of diethyl ether. The yield is 80 %. In addition, this reaction should be taken for 1 hours.
You can still convert the following datas into molecular structure:
1.SMILES: Br[Mg]CCCC
2.InChI: InChI=1/C4H9.BrH.Mg/c1-3-4-2;;/h1,3-4H2,2H3;1H;/q;;+1/p-1/rC4H9BrMg/c1-2-3-4-6-5/h2-4H2,1H3
3.InChIKey: OKULOIZBIQQWSM-HFAMULEAAX